File name: Pandora206s1_BuffaloNY_20230921_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T063237.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230921_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20230921 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20230921T115035.6Z 8664.493467 60 1 45.90 2 81.82 96.74 151.22 63.98 0.00 1 0.00 1 0 25 5.504e-01 2.095e-02 3.620e-01 1.305e-02 7.637188e-01 7.346484e-03 8.524106e-03 -6.000000e+00 3.153833e-01 228.38 -2.00 3.55 -2.00 321.83 0.00e+00 8.378873e-04 4.156065e-03 3.531860e-03 -6.000000e+00 1.668511e-02 284.68 -2.00 20.00 -2.00 321.31 0.00e+00 6.585 0.005 302.00 328.00 3 3.0327e+00 2.7821e-02 7.9674e-02 -6.0000e+00 7.8924e-01 3.9658e-01 3.9505e-02 5.2112e-02 -6.0000e+00 8.6032e-01 -5.3660e-01 3.9438e-02 2.2755e-02 -6.0000e+00 5.0643e-01 2.0714e-01 1.8223e-02 8.1055e-03 -6.0000e+00 2.1800e-01 1.9708e-05 -1.0245e-03 3.6832e-04 7.7038e-05 -6.0000e+00 1.4674e-02 -1.7124e-02 1.7961e-04 12 8 8 10 0 0 84.70 18.28 1.21 -0.01712 -0.02482 24 7 2 8 0 1912.300 14.99 18.28 18.76 21.69 21.69 18.8 943.98 -162239 900000 -41602 900000 -248269 900000 -234888 900000 -244634 900000 900000 900000 -84749 900000 -85014 -57567 900000 102729 -57426 -85161 155824 -72069 900000 -77266 82664 -91169 -12996 66726 -68015 -15838 -40924 9301 141761 173022 -27612 -44757 -32043 32903 53758 15254 47253 10959 33523 37883 40513 1674 -7590 -48522 56266 -1315 6100 8312 9706 16703 33816 9495 10004 31626 3957 -15073 -1632 20995 4042 18128 -5266 9035 1137 5316 29115 1953 13468 15829 16360 6862 15572 -904 6428 -1517 5297 -6171 -957 4842 -2672 -1515 703 -817 1359 1319 -4332 2913 -4158 1221 3206 -4045 -272 -1334 -1689 -383 -976 -851 1349 789 -1438 -1053 -1300 -3486 -1712 -1138 -1749 -2271 996 122 -3095 -1793 252 1470 -1004 -8 -276 764 202 1265 1117 1050 2502 805 1586 2149 758 -366 2951 -78 506 149 -245 -772 71 369 -25 43 -56 -872 -1437 -2061 900000 -529 900000 -5735 900000 -4883 900000 -7064 900000 900000 900000 -1077 900000 -1276 -798 900000 1305 -1061 -2164 1980 -1582 900000 -2053 1050 -3159 -231 848 -1901 -282 -1144 189 1801 2198 -982 -1820 -1262 794 1298 659 1681 599 1533 1685 1750 108 -550 -5487 2359 -105 512 771 974 1719 3136 1170 1271 3214 508 -2260 -218 2454 642 2879 -1131 1642 224 1047 4994 514 3508 4203 4261 1840 3462 -210 1298 -339 1259 -1991 -347 1919 -1266 -751 365 -461 786 784 -2730 1643 -2335 611 1531 -2169 -161 -936 -1390 -363 -933 -894 1301 688 -1148 -838 -1128 -3260 -1664 -1192 -2038 -2757 1324 176 -4668 -2605 341 1887 -1339 -12 -409 1163 304 1792 1534 1532 3462 1101 2079 2951 1111 -619 5373 -159 1078 340 -605 -2020 189 989 -68 109 -134 -1965 -3129 SS 20230921T120733.5Z 8664.505248 65 1 45.52 2 78.75 99.71 148.54 68.83 0.00 1 0.00 1 0 17 3.006e-01 6.938e-03 2.339e-01 4.340e-03 6.064555e-01 2.283296e-03 6.889701e-03 -6.000000e+00 1.688353e-01 228.38 -2.00 3.55 -2.00 321.06 0.00e+00 1.516606e-03 1.057057e-03 4.666933e-04 -6.000000e+00 7.516773e-03 284.68 -2.00 20.00 -2.00 320.45 0.00e+00 4.949 0.002 302.00 328.00 3 3.0524e+00 7.6097e-03 5.8271e-02 -6.0000e+00 4.1997e-01 3.0291e-02 1.0279e-02 3.3242e-02 -6.0000e+00 4.5621e-01 -6.3935e-02 1.0153e-02 1.6952e-02 -6.0000e+00 2.7202e-01 1.6062e-02 4.9071e-03 5.7126e-03 -6.0000e+00 1.1591e-01 1.0807e-04 -1.9451e-04 1.2054e-04 6.0067e-05 -6.0000e+00 7.6779e-03 -1.7782e-02 1.5061e-04 11 8 0 10 0 0 99.41 18.28 0.54 -0.01778 -0.01924 52 16 2 8 0 875.210 14.99 18.28 19.56 21.69 21.69 18.8 948.49 -98940 119163 3050 -43819 -34251 -115454 -110864 -145434 -111890 23590 -64461 -97793 -104544 900000 -49787 6156 -41734 -390 -28647 -28085 15076 -19358 -23273 -24266 -13055 -29291 -6157 -18776 -10375 -21352 11138 -8536 -3183 1797 1132 -16284 -10800 -1536 -1319 -468 -918 1794 1009 578 4271 805 -1608 -7161 1106 -43 1692 2743 302 93 3326 321 2057 1650 3732 -2545 1026 4482 1592 3505 343 848 -128 1112 832 1518 2379 1155 1914 1436 398 -2467 -793 -67 932 -999 -278 -362 -1561 -2247 -983 -1139 731 365 977 701 809 810 247 -366 753 -23 759 141 127 -268 328 -573 -1131 -1260 -1810 -1131 -485 -459 -361 93 717 111 -512 143 -34 281 -142 -310 -165 -114 -399 439 557 348 898 -192 510 638 1131 18 442 -28 -430 -108 -427 58 -62 579 178 248 -248 -270 -698 -571 504 13 -204 -145 -888 -896 -1902 -1326 100 -546 -1283 -1858 900000 -822 70 -865 -6 -630 -654 236 -426 -561 -657 -342 -967 -167 -556 -272 -669 302 -332 -137 81 48 -813 -571 -88 -93 -40 -89 182 109 65 464 93 -194 -939 140 -6 252 413 51 17 635 66 430 346 744 -531 235 991 412 1009 107 253 -38 334 275 582 1004 516 842 601 154 -877 -284 -24 333 -434 -140 -209 -999 -1527 -710 -883 584 302 806 558 595 556 163 -248 566 -20 760 164 147 -308 383 -611 -1101 -1248 -1968 -1286 -577 -587 -460 132 1118 183 -846 225 -51 395 -203 -466 -264 -191 -664 699 861 518 1272 -266 734 876 1751 31 842 -57 -918 -224 -958 136 -148 1411 436 578 -550 -567 -1545 SS 20230921T121523.0Z 8664.510683 68 1 45.75 2 77.35 101.11 147.27 70.88 0.00 1 0.00 1 0 17 2.095e-01 5.476e-03 8.388e-02 2.302e-03 5.566292e-01 1.196474e-03 6.416328e-03 -6.000000e+00 1.176647e-01 228.38 -2.00 3.55 -2.00 320.74 0.00e+00 1.604463e-03 4.943182e-04 4.629696e-04 -6.000000e+00 5.225789e-03 284.68 -2.00 20.00 -2.00 320.09 0.00e+00 4.439 0.002 302.00 328.00 3 2.4381e+00 3.8365e-03 5.2511e-02 -6.0000e+00 2.9273e-01 4.5959e-04 4.9613e-03 2.9935e-02 -6.0000e+00 3.1796e-01 -3.2809e-02 4.6638e-03 1.5320e-02 -6.0000e+00 1.8951e-01 3.8800e-03 2.3092e-03 5.0289e-03 -6.0000e+00 8.0744e-02 3.3878e-04 -6.5985e-05 6.4129e-05 5.4169e-05 -6.0000e+00 5.3398e-03 -1.7833e-02 1.8579e-04 10 0 0 10 0 0 93.23 18.28 0.38 -0.01783 -0.01833 134 41 4 8 0 341.390 14.99 18.28 19.95 21.69 21.69 18.9 951.44 -106118 -66745 -40888 -70014 -87708 -17953 -71182 -62635 -63854 -41267 -44972 -56748 -53315 -37035 -26454 -25626 -13768 -17232 -15134 -19420 -5620 -12543 -16684 -14251 -8602 -15500 -21018 -7900 -23772 -10149 -13057 -8718 -6980 -1224 -5089 -9057 -218 -3746 -892 -380 1035 18 5838 467 2655 459 -221 -1193 1436 143 2122 2524 2294 2935 2620 2199 805 1429 238 370 778 1959 2216 2786 308 1428 837 153 820 496 421 616 328 483 543 -885 -1431 -2036 -1031 -1063 -1007 -865 -1671 -1820 -1082 -312 110 609 697 572 436 713 242 74 665 -526 516 514 414 227 -151 -774 -1072 -564 -986 -1261 -721 -448 -61 119 383 331 200 209 -166 282 -141 93 4 -172 -314 -71 174 247 779 202 311 766 428 215 301 -227 -367 -59 -120 -222 -2 293 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